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Methyl 5-(Hydroxymethyl)pyrazine-2-carboxylate

Methyl 5-(Hydroxymethyl)pyrazine-2-carboxylate - CAS 1262803-64-4

Name: Methyl 5-(Hydroxymethyl)pyrazine-2-carboxylate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB006550
Product Name:	Methyl 5-(Hydroxymethyl)pyrazine-2-carboxylate
CAS:	1262803-64-4
Synonyms:	5-(hydroxymethyl)-2-pyrazinecarboxylic acid methyl ester; methyl 5-(hydroxymethyl)pyrazine-2-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	methyl 5-(hydroxymethyl)pyrazine-2-carboxylate
Description:	Methyl 5-(Hydroxymethyl)pyrazine-2-carboxylate (CAS# 1262803-64-4) is a useful research chemical.
Molecular Weight:	168.15
Molecular Formula:	C7H8N2O3
Canonical SMILES:	COC(=O)C1=CN=C(C=N1)CO
InChI:	InChI=1S/C7H8N2O3/c1-12-7(11)6-3-8-5(4-10)2-9-6/h2-3,10H,4H2,1H3
InChI Key:	CCQQDZWMZNJQFH-UHFFFAOYSA-N
LogP:	-0.24450

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]C5H10ClNO
N-Methyl-N-propylcarbamoyl Chloride
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea
[957292-12-5]C8H10N2O2
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
AU-2018317857-A1	6-amino-7,9-dihydro-8h-purin-8-one derivatives as toll-like receptor 7 (TLR7) agonists as immunostimulants	20170816
CA-3072708-A1	6-amino-7,9-dihydro-8h-purin-8-one derivatives as toll-like receptor 7 (tlr7) agonists as immunostimulants	20170816
CN-110997673-A	6-amino-7, 9-dihydro-8H-purin-8-one derivatives as immunostimulant Toll-like receptor 7(TLR7) agonists	20170816
EP-3668869-A1	6-amino-7,9-dihydro-8h-purin-8-one derivatives as toll-like receptor 7 (tlr7) agonists as immunostimulants	20170816
KR-20200041913-A	6-amino-7,9-dihydro-8H-purin-8-one derivatives as toll-like receptor 7 (TLR7) agonists as immunostimulants	20170816

Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	168.05349212
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	168.05349212
Rotatable Bond Count:	3
Topological Polar Surface Area:	72.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.1